N-(3-iodanyl-4-methyl-phenyl)-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide

Systemtic Name: N-(3-iodanyl-4-methyl-phenyl)-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide Openeye Name: N-(3-iodo-4-methyl-phenyl)-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide CAS Name: N-(3-iodo-4-methylphenyl)-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide IUPAC Name: N-(3-iodo-4-methylphenyl)-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide Traditional Name: N-(3-iodo-4-methyl-phenyl)-3-(3-keto-1,4-benzothiazin-4-yl)propionamide Formula: C18H17IN2O2S MolecularWeight: 452.30925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCN2C(=O)CSC3=CC=CC=C32)I

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCN2C(=O)CSC3=CC=CC=C32)I

InChI

InChI=1S/C18H17IN2O2S/c1-12-6-7-13(10-14(12)19)20-17(22)8-9-21-15-4-2-3-5-16(15)24-11-18(21)23/h2-7,10H,8-9,11H2,1H3,(H,20,22)